| CAS Number | 82767-90-6 |
| Catalog Number | AG00G4F0(AGN-PC-0WNOMP) |
| Chemical Name | ANTHRACENE-9,10-DIPROPIONIC ACID, DISODIUM SALT |
| IUPAC Name | disodium;3-[10-(2-carboxylatoethyl)anthracen-9-yl]propanoate |
| InChI | InChI=1S/C20H18O4.2Na/c21-19(22)11-9-17-13-5-1-2-6-14(13)18(10-12-20(23)24)16-8-4-3-7-15(16)17;;/h1-8H,9-12H2,(H,21,22)(H,23,24);;/q;2*+1/p-2 |
| InChI Key | HYTWSZKAHPYXCU-UHFFFAOYSA-L |
| MDL Number | MFCD00467617 |
| Molecular Formula | C20H16Na2O4 |
| Molecular Weight | 366.3182 |
| SMILES | O=C([O-])CCC1=C2C=CC=CC2=C(CCC([O-])=O)C3=CC=CC=C13.[Na+].[Na+] |
| Synonyms | 82767-90-6,
Sodium 3,3'-(anthracene-9,10-diyl)dipropanoate,
anthracene-9,10-dipropionic acid disodium salt,
SCHEMBL7605312,
KS-00000Y4X,
MFCD00467617,
ACN-049392,
Anthracene-9,10-bis(propionic acid sodium) salt,
ADPA,
HYTWSZKAHPYXCU-UHFFFAOYSA-L,
|
| Complexity | 384 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 366.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 366.324g/mol |
| Monoisotopic Mass | 366.084g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 80.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number